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PDBsum entry 3e6t
Go to PDB code:
Ligand/metal interactions
PDB id
3e6t
2 instances of ligand highlighted
1A2
Ligands
HEM
×2
HEM 901(A)
H4B
×2
H4B 902(A)
1A2
×2
1A2 905(A)
Ligand
1A2
-
5-(4'-Amino-1'-Ethyl-5',8'-Difluoro-1'H- Spiro[piperidine-
4,2'-Quinazoline]-1-Ylcarbonyl) picolinonitrile
Formula:
C
21
H
22
F
2
N
6
O
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
1A2 905(A)
30
30
0
0
Complete
Chiral checks - OK
Additional Information
Validation carried out using
MotiveValidator
. Full validation report can be found in
Validator
DB
.
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3D Viewers:
LIGPLOT
of interactions involving ligand 1A2
List of
interactions
1A2 905(A)
(also representing equivalent ligand 1A2 905(B) )
